BDBM11981 2-chloro-5-{[(4Z)-4-{[4-(methylsulfanyl)phenyl]methylidene}-5-oxo-2-phenyl-4,5-dihydro-1H-imidazol-1-yl]sulfamoyl}benzoic acid::chemical diversity library compound 6

SMILES: CSc1ccc(\C=C2/N=C(N(NS(=O)(=O)c3ccc(Cl)c(c3)C(O)=O)C2=O)c2ccccc2)cc1

InChI Key: InChIKey=JCHAYIXHJPGRAC-BKUYFWCQSA-N

Data: 1 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 11981   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Anthrax Lethal Factor (LF) (Bacillus anthracis)	BDBM11981 (2-chloro-5-{[(4Z)-4-{[4-(methylsulfanyl)phenyl]met...) Show SMILES CSc1ccc(\C=C2/N=C(N(NS(=O)(=O)c3ccc(Cl)c(c3)C(O)=O)C2=O)c2ccccc2)cc1 |c:8| Show InChI InChI=1S/C24H18ClN3O5S2/c1-34-17-9-7-15(8-10-17)13-21-23(29)28(22(26-21)16-5-3-2-4-6-16)27-35(32,33)18-11-12-20(25)19(14-18)24(30)31/h2-14,27H,1H3,(H,30,31)/b21-13-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	2.50E+3	-7.69	3.30E+3	n/a	n/a	n/a	n/a	7.2	27
Montana State University					Assay Description For selected lead compounds from fluorescence-based high-throughput screening, Km and Vmax were calculated using the double-reciprocal Lineweaver-Bur...				J Med Chem 49: 5232-44 (2006) Article DOI: 10.1021/jm0605132 BindingDB Entry DOI: 10.7270/Q20C4T19
					More data for this Ligand-Target Pair